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Details

Stereochemistry ACHIRAL
Molecular Formula C17H21NO
Molecular Weight 255.3547
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3,4,5,6,7,8-HEXAHYDRO-1-((4-METHOXYPHENYL)METHYL)ISOQUINOLINE

SMILES

COC1=CC=C(CC2=NCCC3=C2CCCC3)C=C1

InChI

InChIKey=IYZRINJHKVQAQC-UHFFFAOYSA-N
InChI=1S/C17H21NO/c1-19-15-8-6-13(7-9-15)12-17-16-5-3-2-4-14(16)10-11-18-17/h6-9H,2-5,10-12H2,1H3

HIDE SMILES / InChI

Molecular Formula C17H21NO
Molecular Weight 255.3547
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:33:13 GMT 2023
Edited
by admin
on Sat Dec 16 12:33:13 GMT 2023
Record UNII
VBJ2EL4DFM
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3,4,5,6,7,8-HEXAHYDRO-1-((4-METHOXYPHENYL)METHYL)ISOQUINOLINE
Systematic Name English
ISOQUINOLINE, 3,4,5,6,7,8-HEXAHYDRO-1-((4-METHOXYPHENYL)METHYL)-
Systematic Name English
3,4,5,6,7,8-HEXAHYDRO-1-(4-METHOXYBENZYL)ISOQUINOLINE
Systematic Name English
1-(P-METHOXYBENZYL)-3,4,5,6,7,8-HEXAHYDROISOQUINOLINE
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID60199080
Created by admin on Sat Dec 16 12:33:13 GMT 2023 , Edited by admin on Sat Dec 16 12:33:13 GMT 2023
PRIMARY
ECHA (EC/EINECS)
256-949-8
Created by admin on Sat Dec 16 12:33:13 GMT 2023 , Edited by admin on Sat Dec 16 12:33:13 GMT 2023
PRIMARY
CAS
51072-35-6
Created by admin on Sat Dec 16 12:33:13 GMT 2023 , Edited by admin on Sat Dec 16 12:33:13 GMT 2023
PRIMARY
PUBCHEM
3016591
Created by admin on Sat Dec 16 12:33:13 GMT 2023 , Edited by admin on Sat Dec 16 12:33:13 GMT 2023
PRIMARY
FDA UNII
VBJ2EL4DFM
Created by admin on Sat Dec 16 12:33:13 GMT 2023 , Edited by admin on Sat Dec 16 12:33:13 GMT 2023
PRIMARY